4-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-ol

C23H31NO — CID 12515636

IUPAC4-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-ol
SMILESCC(C)(C)C1(O)CCN(CC(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C23H31NO/c1-22(2,3)23(25)14-16-24(17-15-23)18-21(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13,21,25H,14-18H2,1-3H3
InChIKeyHIYDGURNTXOWEV-UHFFFAOYSA-N
MW337.51 g/mol
LogP4.69
Rot. Bonds4

About 4-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-ol

4-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-ol (PubChem CID 12515636) has the molecular formula C23H31NO and a molecular weight of 337.51 g/mol. Its IUPAC name is 4-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-ol.

Molecular Properties

Compound Name4-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-ol
PubChem CID12515636
Molecular FormulaC23H31NO
Molecular Weight337.51 g/mol
Exact Mass337.24
IUPAC Name4-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-ol
SMILESCC(C)(C)C1(O)CCN(CC(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C23H31NO/c1-22(2,3)23(25)14-16-24(17-15-23)18-21(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13,21,25H,14-18H2,1-3H3
InChIKeyHIYDGURNTXOWEV-UHFFFAOYSA-N
XLogP4.69
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.51
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-ol?
The IUPAC name of 4-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-ol (CID 12515636) is 4-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-ol.
What is the SMILES notation for 4-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-ol?
The canonical SMILES for 4-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-ol is CC(C)(C)C1(O)CCN(CC(c2ccccc2)c2ccccc2)CC1.
What is the InChIKey of 4-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-ol?
The InChIKey is HIYDGURNTXOWEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H31NO/c1-22(2,3)23(25)14-16-24(17-15-23)18-21(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13,21,25H,14-18H2,1-3H3.
What are the key properties of 4-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-ol?
4-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-ol has a molecular weight of 337.51 g/mol, XLogP of 4.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-ol is sourced from PubChem (CID 12515636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).